Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Genome polyprotein' and Ligand = 'BDBM12268'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Genome polyprotein (Hepatitis C virus (HCV genotype 1a, isolate H))	BDBM12268 (1,1-Dimethylethyl-[1(S)-cyclohexyl-2-[(1R,5S)-6,6-...) Show SMILES CCCC(NC(=O)[C@@H]1[C@@H]2[C@H](CN1C(=O)[C@@H](NC(=O)OC(C)(C)C)C1CCCCC1)C2(C)C)C(=O)C(=O)NCC(=O)NCc1cccs1 |r| Show InChI InChI=1S/C34H51N5O7S/c1-7-12-23(28(41)30(43)36-18-24(40)35-17-21-15-11-16-47-21)37-29(42)27-25-22(34(25,5)6)19-39(27)31(44)26(20-13-9-8-10-14-20)38-32(45)46-33(2,3)4/h11,15-16,20,22-23,25-27H,7-10,12-14,17-19H2,1-6H3,(H,35,40)(H,36,43)(H,37,42)(H,38,45)/t22-,23?,25-,26-,27-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	60	-41.9	n/a	n/a	n/a	n/a	n/a	6.5	30
Schering-Plough Research Institute					Assay Description Proteolytic cleavage of the ester linkage between the Nva (L-norvaline) and the chromophore (PAP) was monitored for change in absorbance at 370 nm. I...				J Med Chem 49: 6074-86 (2006) Article DOI: 10.1021/jm060325b BindingDB Entry DOI: 10.7270/Q2DF6PF6
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